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3-octan-3-yloxycarbonylbenzoate

3-octan-3-yloxycarbonylbenzoate

Systemtic Name:3-octan-3-yloxycarbonylbenzoate
Openeye Name:3-(1-ethylhexoxycarbonyl)benzoate
CAS Name:3-[octan-3-yloxy(oxo)methyl]benzoate
IUPAC Name:3-octan-3-yloxycarbonylbenzoate
Traditional Name:3-(1-ethylhexoxycarbonyl)benzoate
Formula: C16H21O4-
MolecularWeight: 277.33554
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC=CC(=C1)C(=O)[O-]


Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC=CC(=C1)C(=O)[O-]


InChI

InChI=1S/C16H22O4/c1-3-5-6-10-14(4-2)20-16(19)13-9-7-8-12(11-13)15(17)18/h7-9,11,14H,3-6,10H2,1-2H3,(H,17,18)/p-1


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